8-bromanyl-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]purine-2,6-dione

Systemtic Name: 8-bromanyl-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]purine-2,6-dione Openeye Name: 8-bromo-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]purine-2,6-dione CAS Name: 8-bromo-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]purine-2,6-dione IUPAC Name: 8-bromo-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]purine-2,6-dione Traditional Name: 8-bromo-1,3-dimethyl-9-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]xanthine Formula: C11H11BrN6O3 MolecularWeight: 355.14744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)CN2C3=C(C(=O)N(C(=O)N3C)C)N=C2Br

Isomeric SMILES

CC1=NN=C(O1)CN2C3=C(C(=O)N(C(=O)N3C)C)N=C2Br

InChI

InChI=1S/C11H11BrN6O3/c1-5-14-15-6(21-5)4-18-8-7(13-10(18)12)9(19)17(3)11(20)16(8)2/h4H2,1-3H3